Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f79fad0d0fffeb37aaacc39bf554819b",
"space_group_name": "P 1",
"unit_cell": {
"a": 21.162,
"b": 25.836,
"c": 38.564,
"alpha": 104.754,
"beta": 96.562,
"gamma": 92.030
},
"wavelengths": [1.28300],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37,2.185],
"number_observations_unique": 6865,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.131
},
{
"type": "R(meas)",
"value": 0.185
},
{
"type": "I/SigI",
"value": 3.94
},
{
"type": "Completeness",
"value": 84.5
},
{
"type": "Redundancy",
"value": 1.89
},
{
"type": "CC(1/2)",
"value": 0.969
}
]
},
"refln_shells": [
{
"resolution_limits": [2.32,2.19],
"number_observations_unique": 1000,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.452
},
{
"type": "R(meas)",
"value": 0.639
},
{
"type": "I/SigI",
"value": 1.60
},
{
"type": "Completeness",
"value": 76.8
},
{
"type": "CC(1/2)",
"value": 0.769
}
]
}
]
}